3-ethenyl-3-(phenylmethyl)heptan-2-one

Systemtic Name: 3-ethenyl-3-(phenylmethyl)heptan-2-one Openeye Name: 3-benzyl-3-vinyl-heptan-2-one CAS Name: 3-ethenyl-3-(phenylmethyl)-2-heptanone IUPAC Name: 3-benzyl-3-ethenylheptan-2-one Traditional Name: 3-benzyl-3-butyl-pent-4-en-2-one Formula: C16H22O MolecularWeight: 230.34528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=CC=CC=C1)(C=C)C(=O)C

Isomeric SMILES

CCCCC(CC1=CC=CC=C1)(C=C)C(=O)C

InChI

InChI=1S/C16H22O/c1-4-6-12-16(5-2,14(3)17)13-15-10-8-7-9-11-15/h5,7-11H,2,4,6,12-13H2,1,3H3